2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide

C17H21N3O3 — CID 95786376

IUPAC2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide
SMILESCOc1ccc2cc(C(=O)N3CCC[C@H](CC(N)=O)C3)[nH]c2c1
InChIInChI=1S/C17H21N3O3/c1-23-13-5-4-12-8-15(19-14(12)9-13)17(22)20-6-2-3-11(10-20)7-16(18)21/h4-5,8-9,11,19H,2-3,6-7,10H2,1H3,(H2,18,21)/t11-/m1/s1
InChIKeyKCKWVSHVEOMBDN-LLVKDONJSA-N
MW315.37 g/mol
LogP1.90
Rot. Bonds4

About 2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide

2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide (PubChem CID 95786376) has the molecular formula C17H21N3O3 and a molecular weight of 315.37 g/mol. Its IUPAC name is 2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide.

Molecular Properties

Compound Name2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide
PubChem CID95786376
Molecular FormulaC17H21N3O3
Molecular Weight315.37 g/mol
Exact Mass315.16
IUPAC Name2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide
SMILESCOc1ccc2cc(C(=O)N3CCC[C@H](CC(N)=O)C3)[nH]c2c1
InChIInChI=1S/C17H21N3O3/c1-23-13-5-4-12-8-15(19-14(12)9-13)17(22)20-6-2-3-11(10-20)7-16(18)21/h4-5,8-9,11,19H,2-3,6-7,10H2,1H3,(H2,18,21)/t11-/m1/s1
InChIKeyKCKWVSHVEOMBDN-LLVKDONJSA-N
XLogP1.90
TPSA88.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(4,6-dimethylpyrimidin-2-yl)oxypiperidin-1-yl]-(6-methoxy-1H-indol-2-yl)methanone
CID 122257934
(2R)-4-(6-methoxy-1H-indole-2-carbonyl)morpholine-2-carboxamide
CID 94825635
1-(6-butoxy-1H-indole-2-carbonyl)piperidine-3-carboxamide
CID 71895157
(6-methoxy-1H-indol-2-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
CID 4909282
3-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]oxypyrazine-2-carbonitrile
CID 91628023
(2,6-dimethylmorpholin-4-yl)-(6-methoxy-1H-indol-2-yl)methanone
CID 4870192
(6-hydroxy-1H-indol-2-yl)-[3-[(3,4,5-trimethoxyphenyl)methyl]piperidin-1-yl]methanone
CID 139988539
N-[(2S)-butan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]acetamide
CID 93076979
6-cyclopropyl-2-[[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]methyl]pyridazin-3-one
CID 126927238
(3,4-dimethoxyphenyl)-[4-(6-methoxy-1H-indole-2-carbonyl)piperazin-1-yl]methanone
CID 38486486
4-[1-(6-methoxy-1H-indole-2-carbonyl)pyrrolidin-3-yl]oxy-6-methylpyran-2-one
CID 90628768
N-[(2,4-dimethoxyphenyl)methyl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]acetamide
CID 50816995

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide?
The IUPAC name of 2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide (CID 95786376) is 2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide.
What is the SMILES notation for 2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide?
The canonical SMILES for 2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide is COc1ccc2cc(C(=O)N3CCC[C@H](CC(N)=O)C3)[nH]c2c1.
What is the InChIKey of 2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide?
The InChIKey is KCKWVSHVEOMBDN-LLVKDONJSA-N. The full InChI is InChI=1S/C17H21N3O3/c1-23-13-5-4-12-8-15(19-14(12)9-13)17(22)20-6-2-3-11(10-20)7-16(18)21/h4-5,8-9,11,19H,2-3,6-7,10H2,1H3,(H2,18,21)/t11-/m1/s1.
What are the key properties of 2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide?
2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide has a molecular weight of 315.37 g/mol, XLogP of 1.90, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]acetamide is sourced from PubChem (CID 95786376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).